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[Tris(cyclopentadienyl)(triphenylphosphineoxide)neodymium(iii)]
SpectraBase Compound ID Gd4divfTB3z
InChI InChI=1S/C18H15OP.3C5H5.Nd/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-2-4-5-3-1;/h1-15H;3*1-5H;
InChIKey BFXHXUCLZDDKLE-UHFFFAOYSA-N
Mol Weight 618.8 g/mol
Molecular Formula C33H31NdOP
Exact Mass 616.118983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DkK64tC1hR
Name [Tris(cyclopentadienyl)(triphenylphosphineoxide)neodymium(iii)]
Comments Note: The molecular formula of the structure shown is C33H31NdOP - which differs from the formula reported for the mass spectrum (C33H30NdOP)
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Formula C33H30NdOP
InChI InChI=1S/C18H15OP.3C5H5.Nd/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-2-4-5-3-1;/h1-15H;3*1-5H;
InChIKey BFXHXUCLZDDKLE-UHFFFAOYSA-N
Molecular Weight 618.826 g/mol
SMILES [PH+]([Nd](C1C=CC=C1)(C1C=CC=C1)C1C=CC=C1)([O-])(c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-00or-5090000000-ecc6c109b4e80d738f9f
Source of Spectrum AG-565-29-0
Synonyms Tris(cyclopenta-2,4-dien-1-yl)(triphenylphosphoroso)neodymium
Wiley ID 1411257